Ethyl 3-Phenyl-3-(piperidin-4-yl)propanoate Hydrochloride - CAS 1171672-92-6
Catalog: |
BB072972 |
Product Name: |
Ethyl 3-Phenyl-3-(piperidin-4-yl)propanoate Hydrochloride |
CAS: |
1171672-92-6 |
Synonyms: |
ethyl 3-phenyl-3-(piperidin-4-yl)propanoate hydrochloride; ethyl 3-phenyl-3-piperidin-4-ylpropanoate; hydrochloride; ethyl3-phenyl-3-(piperidin-4-yl)propanoatehydrochloride |
IUPAC Name: | ethyl 3-phenyl-3-piperidin-4-ylpropanoatehydrochloride |
Molecular Weight: | 261.37 + 36.46 |
Molecular Formula: | C16H23NO2·HCl |
Canonical SMILES: | CCOC(=O)CC(C1CCNCC1)C2=CC=CC=C2.Cl |
InChI: | InChI=1S/C16H23NO2.ClH/c1-2-19-16(18)12-15(13-6-4-3-5-7-13)14-8-10-17-11-9-14/h3-7,14-15,17H,2,8-12H2,1H31H |
InChI Key: | JZGRHAQYNAJXMM-UHFFFAOYSA-N |
Complexity: | 268 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.1495567 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 297.1495567 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 38.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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